Geometry & MOs

Info

ID:	441814
PubChem CID:	135245183
Reduced:	N3H39C50 (1)
Stoich.:	A3B39C50 (1)
Weight, g/mol:	579.267448
ΔH_f, kcal/mol:	228.2
Dipole, Da:	2.41
IP(EA), eV:	-8.14(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[4-(9,9-dimethyl-7,8-dihydrofluoren-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine

Drug info:

PubChemData

Smile

CC(C1=C(C2=CC=CC=C2C=C1)C3=CC=C(C=C3)N4C5=C(C6=CC=CC=C6C=C5)C7=CC=CC=C74)N=C(C8=CC=CC=C8)N=C(C)C9=CC=CCC=C9

DOS

IR

Vibrations